β-D-Glucopyranosyl (1α,3β,4α,22R)-1,3,22-trihydroxy-24-oxo-9,19-cyclolanostan-28-oate

CAS Registry Number®

292167-43-2
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CAS Name

β-D-Glucopyranosyl (1α,3β,4α,22R)-1,3,22-trihydroxy-24-oxo-9,19-cyclolanostan-28-oate

Molecular Formula

C36H58O11

Molecular Mass

666.84

Cite this Page

β-D-Glucopyranosyl (1α,3β,4α,22R)-1,3,22-trihydroxy-24-oxo-9,19-cyclolanostan-28-oate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=292167-43-2 (retrieved 2024-09-19) (CAS RN: 292167-43-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C36H58O11/c1-17(2)20(38)13-21(39)18(3)19-9-10-33(5)23-7-8-24-34(6,31(45)47-30-29(44)28(43)27(42)22(15-37)46-30)25(40)14-26(41)36(24)16-35(23,36)12-11-32(19,33)4/h17-19,21-30,37,39-44H,7-16H2,1-6H3/t18-,19+,21+,22+,23-,24-,25-,26-,27+,28-,29+,30-,32+,33-,34-,35-,36+/m0/s1

InChIKey

InChIKey=DQWGJNAMAZRGFN-QACJJIHMSA-N

SMILES

O[C@@H]1[C@@]23[C@@]4(C2)[C@]([C@@]5(C)[C@](C)(CC4)[C@@]([C@@H]([C@@H](CC(C(C)C)=O)O)C)(CC5)[H])(CC[C@]3([C@@](C(O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)=O)(C)[C@@H](O)C1)[H])[H]

Canonical SMILES

O=C(OC1OC(CO)C(O)C(O)C1O)C2(C)C(O)CC(O)C34CC54CCC6(C)C(CCC6(C)C5CCC23)C(C)C(O)CC(=O)C(C)C

Other Names for this Substance

  • 9,19-Cyclolanostan-28-oic acid, 1,3,22-trihydroxy-24-oxo-, β-D-glucopyranosyl ester, (1α,3β,4α,22R)-
  • β-D-Glucopyranosyl (1α,3β,4α,22R)-1,3,22-trihydroxy-24-oxo-9,19-cyclolanostan-28-oate
  • Cyclopassifloside VI